4-(3-chloro-1,2-dihydropyridin-2-yl)piperidin-4-ol

C10H15ClN2O — CID 67466095

IUPAC4-(3-chloro-1,2-dihydropyridin-2-yl)piperidin-4-ol
SMILESOC1(C2NC=CC=C2Cl)CCNCC1
InChIInChI=1S/C10H15ClN2O/c11-8-2-1-5-13-9(8)10(14)3-6-12-7-4-10/h1-2,5,9,12-14H,3-4,6-7H2
InChIKeyLTPNVFHFZZFTQM-UHFFFAOYSA-N
MW214.70 g/mol
LogP0.71
Rot. Bonds1

About 4-(3-chloro-1,2-dihydropyridin-2-yl)piperidin-4-ol

4-(3-chloro-1,2-dihydropyridin-2-yl)piperidin-4-ol (PubChem CID 67466095) has the molecular formula C10H15ClN2O and a molecular weight of 214.70 g/mol. Its IUPAC name is 4-(3-chloro-1,2-dihydropyridin-2-yl)piperidin-4-ol.

Molecular Properties

Compound Name4-(3-chloro-1,2-dihydropyridin-2-yl)piperidin-4-ol
PubChem CID67466095
Molecular FormulaC10H15ClN2O
Molecular Weight214.70 g/mol
Exact Mass214.09
IUPAC Name4-(3-chloro-1,2-dihydropyridin-2-yl)piperidin-4-ol
SMILESOC1(C2NC=CC=C2Cl)CCNCC1
InChIInChI=1S/C10H15ClN2O/c11-8-2-1-5-13-9(8)10(14)3-6-12-7-4-10/h1-2,5,9,12-14H,3-4,6-7H2
InChIKeyLTPNVFHFZZFTQM-UHFFFAOYSA-N
XLogP0.71
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.70
LogP ≤ 50.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-Chloro-1,2-dihydropyridin-2-yl)piperidin-4-ol;hydrochloride
CID 67466094
tert-butyl 3-chloro-2-(4-hydroxypiperidin-4-yl)-2H-pyridine-1-carboxylate
CID 67466407
4-(1,2-Dihydropyridin-2-yl)piperidin-4-ol
CID 69090804
2-(4-hydroxypiperidin-4-yl)-2H-pyridine-1-carbonyl chloride
CID 87615064
4-[5-(1-Aminoethyl)-1,2-dihydropyridin-2-yl]-1-methylpiperidin-4-ol
CID 143709591

Frequently Asked Questions

What is the IUPAC name of 4-(3-chloro-1,2-dihydropyridin-2-yl)piperidin-4-ol?
The IUPAC name of 4-(3-chloro-1,2-dihydropyridin-2-yl)piperidin-4-ol (CID 67466095) is 4-(3-chloro-1,2-dihydropyridin-2-yl)piperidin-4-ol.
What is the SMILES notation for 4-(3-chloro-1,2-dihydropyridin-2-yl)piperidin-4-ol?
The canonical SMILES for 4-(3-chloro-1,2-dihydropyridin-2-yl)piperidin-4-ol is OC1(C2NC=CC=C2Cl)CCNCC1.
What is the InChIKey of 4-(3-chloro-1,2-dihydropyridin-2-yl)piperidin-4-ol?
The InChIKey is LTPNVFHFZZFTQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2O/c11-8-2-1-5-13-9(8)10(14)3-6-12-7-4-10/h1-2,5,9,12-14H,3-4,6-7H2.
What are the key properties of 4-(3-chloro-1,2-dihydropyridin-2-yl)piperidin-4-ol?
4-(3-chloro-1,2-dihydropyridin-2-yl)piperidin-4-ol has a molecular weight of 214.70 g/mol, XLogP of 0.71, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chloro-1,2-dihydropyridin-2-yl)piperidin-4-ol is sourced from PubChem (CID 67466095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).